Benzene → HCID 20352652, compound

HRID 1131005Notes

Reaction equation

HRID 1131005 reaction equation
[CH2:39]([CH3:40])[O:41][C:42](=[O:43])[Cl:44].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[c:1]1([CH:7]([N:8]2[CH2:9][C:10]([CH2:14][c:15]3[cH:16][c:17]4[c:18]([cH:19][cH:20]3)[O:21][CH2:22][CH2:23][O:24]4)([CH3:25])[NH:11][CH2:12][CH2:13]2)[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[c:1]1([CH:7]([N:8]2[CH2:9][C:10]([CH2:14][c:15]3[cH:16][c:17]4[c:18]([cH:19][cH:20]3)[O:21][CH2:22][CH2:23][O:24]4)([CH3:25])[N:11]([C:42]([O:41][CH2:39][CH3:40])=[O:43])[CH2:12][CH2:13]2)[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 8471TriethylamineHCID 10928Ethyl chloroformateHCID 20352656HCID 20352656, compound

Product 1

HCID 20352652HCID 20352652, compound

Sources & evidence

ORD record
ord-dc3e3d968cd748afad1670dfa441dd68
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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